Entry |
|
Name |
Metipranolol hydrochloride; Optipranolol (TN) |
Formula |
C17H27NO4. HCl
|
Exact mass |
345.1707
|
Mol weight |
345.8615
|
Structure |
|
Simcomp |
|
Class |
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
Ophthalmic agent
DG03201 Intraocular pressure lowering agent
|
Remark |
|
Efficacy |
Antiglaucoma, beta-Adrenergic receptor antagonist |
Comment |
Propranolol derivative
|
Target |
|
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
|
Interaction |
|
Structure map |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
S SENSORY ORGANS
S01 OPHTHALMOLOGICALS
S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
S01ED Beta blocking agents
S01ED04 Metipranolol
D02081 Metipranolol hydrochloride
Drug groups [BR:br08330]
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
DG01137 Metipranolol
D02081 Metipranolol hydrochloride
Ophthalmic agent
DG03201 Intraocular pressure lowering agent
DG01137 Metipranolol
D02081 Metipranolol hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB
D02081 Metipranolol hydrochloride
Drug groups [BR:br08330]
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
DG01137 Metipranolol
Ophthalmic agent
DG03201 Intraocular pressure lowering agent
DG01137 Metipranolol
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 23
1 X Cl 23.7924 -31.0632
2 O2a O 16.8700 -25.3400
3 C1b C 18.0600 -24.6400
4 C1c C 19.1800 -25.3400
5 C1b C 20.3700 -24.6400
6 O1a O 19.1800 -26.7400
7 N1b N 21.5600 -25.3400
8 C1c C 22.7500 -24.6400
9 C1a C 24.0100 -25.3400
10 C1a C 22.7500 -23.1700
11 C8y C 16.8700 -26.7400
12 C8y C 15.6576 -27.4400
13 C8y C 15.6576 -28.8400
14 C8y C 16.8700 -29.5400
15 C8y C 18.0824 -28.8400
16 C8x C 18.0824 -27.4400
17 C1a C 19.2779 -29.5304
18 O7a O 16.8700 -30.9400
19 C7a C 15.6576 -31.6400
20 C1a C 14.4621 -29.5304
21 C1a C 14.4621 -30.9496
22 O6a O 15.6575 -33.0398
23 C1a C 14.4621 -26.7496
BOND 22
1 2 3 1
2 3 4 1
3 4 5 1
4 4 6 1
5 5 7 1
6 7 8 1
7 8 9 1
8 8 10 1
9 2 11 1
10 11 12 2
11 12 13 1
12 13 14 2
13 14 15 1
14 15 16 2
15 11 16 1
16 15 17 1
17 14 18 1
18 18 19 1
19 13 20 1
20 19 21 1
21 19 22 2
22 12 23 1
|